2-[(2-cyclopentylethylcarbamoylamino)methyl]-4-ethanoylsulfanyl-butanoic acid

Systemtic Name: 2-[(2-cyclopentylethylcarbamoylamino)methyl]-4-ethanoylsulfanyl-butanoic acid Openeye Name: 4-acetylsulfanyl-2-[(2-cyclopentylethylcarbamoylamino)methyl]butanoic acid CAS Name: 4-(acetylthio)-2-[[[(2-cyclopentylethylamino)-oxomethyl]amino]methyl]butanoic acid IUPAC Name: 4-acetylsulfanyl-2-[(2-cyclopentylethylcarbamoylamino)methyl]butanoic acid Traditional Name: 4-(acetylthio)-2-[(2-cyclopentylethylcarbamoylamino)methyl]butyric acid Formula: C15H26N2O4S MolecularWeight: 330.44294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(CNC(=O)NCCC1CCCC1)C(=O)O

Isomeric SMILES

CC(=O)SCCC(CNC(=O)NCCC1CCCC1)C(=O)O

InChI

InChI=1S/C15H26N2O4S/c1-11(18)22-9-7-13(14(19)20)10-17-15(21)16-8-6-12-4-2-3-5-12/h12-13H,2-10H2,1H3,(H,19,20)(H2,16,17,21)